#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eec s SER 2 N 0.00 -0.24 0.12 1.61 1.04 -1.26 -5.19 113.70 109.78 2eec s SER 2 Ca 0.00 0.39 -0.25 0.00 0.48 0.00 0.00 55.95 56.57 2eec s SER 2 Cb 0.00 0.37 0.08 0.00 0.10 0.00 0.00 66.02 66.57 2eec s SER 2 CO 0.00 -0.13 1.06 -0.94 0.98 0.00 0.00 173.24 174.20 2eec s SER 3 N -0.34 -0.10 0.00 7.02 1.04 -1.26 -5.16 113.70 114.89 2eec s SER 3 Ca 0.04 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.06 2eec s SER 3 Cb -0.03 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.50 2eec s SER 3 CO -0.08 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 173.97 2eec n GLY 4 N -0.55 0.19 2.93 7.32 0.00 -1.26 -5.10 105.19 108.73 2eec n GLY 4 Ca -0.05 -1.37 -0.13 0.00 0.00 0.00 0.00 46.02 44.46 2eec n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eec s SER 5 N -0.59 -0.11 0.09 1.61 0.15 -1.26 -5.16 113.70 108.43 2eec s SER 5 Ca 0.00 0.29 0.06 0.00 0.70 0.00 0.00 55.95 57.00 2eec s SER 5 Cb 0.00 0.19 -0.03 0.00 -1.71 0.00 0.00 66.02 64.46 2eec s SER 5 CO 0.00 -0.14 -0.17 -0.44 1.20 0.00 0.00 173.24 173.70 2eec s SER 6 N 1.03 2.01 -0.97 5.45 0.01 -1.26 -5.05 113.70 114.92 2eec s SER 6 Ca -0.08 -0.65 -0.22 0.00 1.31 0.00 0.00 55.95 56.31 2eec s SER 6 Cb -0.10 -0.08 -0.12 0.00 0.21 0.00 0.00 66.02 65.92 2eec s SER 6 CO -0.05 -0.03 1.92 0.61 0.41 0.00 0.00 173.24 176.10 2eec n GLY 7 N 1.17 1.85 4.03 3.44 0.00 -1.26 -4.89 105.19 109.52 2eec n GLY 7 Ca -0.20 -1.01 -0.19 0.00 0.00 0.00 0.00 46.02 44.62 2eec n GLY 7 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2eec s PHE 8 N 7.76 1.70 0.98 1.61 0.08 -1.26 -5.07 117.98 123.77 2eec s PHE 8 Ca 0.62 -0.66 -0.15 0.00 0.12 0.00 0.00 56.93 56.86 2eec s PHE 8 Cb 0.07 -2.24 -0.03 0.00 -0.57 0.00 0.00 43.02 40.26 2eec s PHE 8 CO 0.13 -0.99 -0.11 0.36 -0.10 0.00 0.00 175.22 174.51 2eec n LYS 9 N -2.15 -0.29 -3.97 0.44 2.85 -1.26 -5.02 118.16 108.76 2eec n LYS 9 Ca 0.14 -0.06 -0.11 0.00 -1.05 0.00 0.00 58.31 57.23 2eec n LYS 9 Cb 0.61 -1.53 -0.12 0.00 -0.65 0.00 0.00 35.03 33.34 2eec n LYS 9 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2eec s VAL 10 N -2.24 0.15 0.03 0.58 1.01 -1.26 -5.16 120.40 113.52 2eec s VAL 10 Ca 0.50 -0.58 -0.07 0.00 0.00 0.00 0.00 61.98 61.84 2eec s VAL 10 Cb -0.18 -0.23 -0.05 0.00 0.00 0.00 0.00 36.38 35.93 2eec s VAL 10 CO 0.72 -0.27 0.29 0.00 0.00 0.00 0.00 175.10 175.84 2eec s ARG 11 N -0.89 3.60 -0.01 2.72 1.70 -1.26 -5.10 118.95 119.71 2eec s ARG 11 Ca -0.09 -0.06 0.04 0.00 -0.47 0.00 0.00 55.73 55.16 2eec s ARG 11 Cb -0.06 -3.05 -0.01 0.00 -0.57 0.00 0.00 34.95 31.26 2eec s ARG 11 CO -0.00 0.62 -0.13 0.08 -1.08 0.00 0.00 175.30 174.79 2eec s VAL 12 N -1.34 0.99 0.18 4.99 1.01 -1.26 -5.15 120.40 119.82 2eec s VAL 12 Ca 0.29 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.76 2eec s VAL 12 Cb -0.13 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2eec s VAL 12 CO 0.17 0.25 0.11 -0.83 0.00 0.00 0.00 175.10 174.81 2eec s GLY 13 N -0.36 1.67 0.18 4.51 0.00 -1.26 -5.13 107.32 106.93 2eec s GLY 13 Ca 0.04 -1.29 0.06 0.00 0.00 0.00 0.00 44.72 43.54 2eec s GLY 13 CO -0.00 -1.31 0.08 -0.54 0.00 0.00 0.00 173.10 171.33 2eec s GLU 14 N -3.20 2.68 0.74 2.90 0.41 -1.26 -5.12 118.70 115.87 2eec s GLU 14 Ca 0.31 -1.00 -0.12 0.00 -0.41 0.00 0.00 54.97 53.75 2eec s GLU 14 Cb -0.09 -2.51 0.04 0.00 -1.78 0.00 0.00 34.13 29.79 2eec s GLU 14 CO 0.23 0.46 1.10 -1.25 -0.49 0.00 0.00 175.26 175.30 2eec s PRO 15 N -3.13 2.39 0.00 0.39 0.04 -1.26 -5.03 135.00 128.40 2eec s PRO 15 Ca 0.30 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.57 2eec s PRO 15 Cb -0.09 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2eec s PRO 15 CO 0.21 -1.55 0.08 0.41 0.04 0.00 0.00 177.00 176.20 2eec n GLY 16 N -1.03 -2.45 2.67 0.56 0.00 -1.26 -4.76 105.19 98.93 2eec n GLY 16 Ca 0.09 0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2eec n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eec n GLN 17 N -0.08 0.00 -2.90 1.61 0.00 -1.26 -4.96 117.38 109.79 2eec n GLN 17 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 57.00 56.79 2eec n GLN 17 Cb 0.00 -0.80 0.09 0.00 0.00 0.00 0.00 30.24 29.53 2eec n GLN 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2eec s ALA 18 N -1.10 4.41 0.00 2.61 0.00 -1.26 -4.99 121.76 121.42 2eec s ALA 18 Ca 0.49 -2.10 0.00 0.00 0.00 0.00 0.00 51.96 50.35 2eec s ALA 18 Cb -0.61 -1.60 0.00 0.00 0.00 0.00 0.00 23.12 20.90 2eec s ALA 18 CO 0.48 -1.15 0.00 0.41 0.00 0.00 0.00 175.76 175.49 2eec n GLY 19 N -2.50 0.77 3.37 0.00 0.00 -1.26 -5.08 105.19 100.49 2eec n GLY 19 Ca 0.17 -0.64 -0.45 0.00 0.00 0.00 0.00 46.02 45.11 2eec n GLY 19 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2eec s ASN 20 N -0.22 6.14 0.44 1.61 2.47 -1.26 -4.92 114.94 119.19 2eec s ASN 20 Ca 0.00 -1.42 0.23 0.00 0.42 0.00 0.00 52.86 52.09 2eec s ASN 20 Cb 0.00 -2.18 0.98 0.00 -1.45 0.00 0.00 41.25 38.60 2eec s ASN 20 CO 0.00 -0.68 1.86 1.55 -3.72 0.00 0.00 177.10 176.11 2eec h PRO 21 N 8.77 0.00 -0.58 0.43 0.13 -1.94 -3.11 132.00 135.69 2eec h PRO 21 Ca -0.28 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 2eec h PRO 21 Cb 1.11 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 2eec h PRO 21 CO 0.90 0.25 0.34 0.00 -0.23 0.00 0.00 178.00 179.26 2eec h ALA 22 N 1.75 0.74 -1.02 -0.56 0.00 -1.91 -2.29 119.26 115.96 2eec h ALA 22 Ca -0.00 -0.08 0.26 0.00 0.00 0.00 0.00 54.91 55.09 2eec h ALA 22 Cb 0.68 -0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.16 2eec h ALA 22 CO 0.03 0.23 0.68 -0.07 0.00 0.00 0.00 179.25 180.12 2eec h LEU 23 N 0.78 0.36 -9.70 0.00 3.38 -1.94 -3.39 115.31 104.79 2eec h LEU 23 Ca 0.21 0.06 -0.53 0.00 0.09 0.00 0.00 57.88 57.71 2eec h LEU 23 Cb 0.00 0.00 0.05 0.00 0.09 0.00 0.00 40.66 40.80 2eec h LEU 23 CO -0.04 0.09 0.77 -0.69 0.09 0.00 0.00 178.44 178.66 2eec s VAL 24 N -5.38 2.73 0.25 1.22 1.01 -0.86 -4.89 120.40 114.47 2eec s VAL 24 Ca -0.08 0.58 0.05 0.00 0.00 0.00 0.00 61.98 62.54 2eec s VAL 24 Cb 0.24 -3.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 2eec s VAL 24 CO 0.79 0.08 -0.03 -0.55 0.00 0.00 0.00 175.10 175.39 2eec s SER 25 N 0.55 2.26 -0.10 3.32 0.15 -0.85 -4.46 113.70 114.57 2eec s SER 25 Ca 0.61 -1.20 -0.07 0.00 0.70 0.00 0.00 55.95 56.00 2eec s SER 25 Cb -0.42 -0.07 0.04 0.00 -1.71 0.00 0.00 66.02 63.86 2eec s SER 25 CO 0.40 -0.43 0.26 0.00 1.20 0.00 0.00 173.24 174.67 2eec s ALA 26 N -3.23 -0.62 0.15 5.45 0.00 -1.26 0.11 121.76 122.37 2eec s ALA 26 Ca 0.28 0.88 -0.22 0.00 0.00 0.00 0.00 51.96 52.90 2eec s ALA 26 Cb 0.05 -0.54 0.07 0.00 0.00 0.00 0.00 23.12 22.70 2eec s ALA 26 CO 0.10 -0.16 0.58 1.52 0.00 0.00 0.00 175.76 177.80 2eec s TYR 27 N 0.68 -0.51 -2.96 0.00 1.13 -0.95 -5.02 117.35 109.73 2eec s TYR 27 Ca -0.04 0.30 0.00 0.00 -1.41 0.00 0.00 57.07 55.92 2eec s TYR 27 Cb -0.06 0.53 0.00 0.00 -1.10 0.00 0.00 41.96 41.33 2eec s TYR 27 CO -0.04 -0.83 0.00 0.41 -2.51 0.00 0.00 175.55 172.58 2eec n GLY 28 N -0.34 -1.00 0.09 5.49 0.00 -1.26 -1.47 105.19 106.69 2eec n GLY 28 Ca -0.17 -0.99 0.12 0.00 0.00 0.00 0.00 46.02 44.97 2eec n GLY 28 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2eec h THR 29 N 0.00 0.00 0.00 2.61 2.02 -1.89 -3.25 112.91 112.40 2eec h THR 29 Ca 0.00 -0.70 -0.11 0.00 0.77 0.00 0.00 66.41 66.36 2eec h THR 29 Cb 0.00 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2eec h THR 29 CO 0.00 0.00 -1.21 1.23 0.37 0.00 0.00 175.52 175.91 2eec h GLY 30 N 4.30 0.00 1.52 2.16 0.00 -1.76 -3.27 103.07 106.02 2eec h GLY 30 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 2eec h GLY 30 CO 0.00 0.00 -0.95 1.41 0.00 0.00 0.00 176.54 177.00 2eec h LEU 31 N 0.00 0.00 -0.16 3.11 3.38 -1.90 -3.32 115.31 116.42 2eec h LEU 31 Ca -0.10 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.64 2eec h LEU 31 Cb 1.39 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.14 2eec h LEU 31 CO 0.03 0.55 -0.97 1.05 0.09 0.00 0.00 178.44 179.20 2eec h GLU 32 N 0.00 0.35 -2.55 1.13 4.11 -1.69 -3.42 114.58 112.51 2eec h GLU 32 Ca -0.08 -0.40 0.12 0.00 0.07 0.00 0.00 59.36 59.07 2eec h GLU 32 Cb 1.49 0.12 -0.09 0.00 0.50 0.00 0.00 28.75 30.77 2eec h GLU 32 CO 0.06 1.09 0.40 0.20 0.07 0.00 0.00 179.01 180.82 2eec s GLY 33 N -4.47 -0.28 -0.44 1.06 0.00 -1.23 -4.74 107.32 97.22 2eec s GLY 33 Ca -0.05 0.23 -0.11 0.00 0.00 0.00 0.00 44.72 44.79 2eec s GLY 33 CO 0.86 0.06 0.30 -0.32 0.00 0.00 0.00 173.10 174.00 2eec s GLY 34 N -2.83 2.00 -0.51 0.20 0.00 0.58 -4.33 107.32 102.42 2eec s GLY 34 Ca 0.09 -2.20 -0.18 0.00 0.00 0.00 0.00 44.72 42.44 2eec s GLY 34 CO -0.00 1.01 0.55 -1.59 0.00 0.00 0.00 173.10 173.07 2eec s THR 35 N 1.47 5.01 -0.09 0.90 2.01 -1.26 -1.79 115.64 121.88 2eec s THR 35 Ca 0.04 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 60.90 2eec s THR 35 Cb -0.24 -4.28 -0.03 0.00 0.01 0.00 0.00 72.50 67.96 2eec s THR 35 CO 0.03 -0.79 1.32 -0.89 -0.69 0.00 0.00 174.62 173.59 2eec s THR 36 N 2.23 4.08 0.00 -0.82 2.01 -1.26 -2.91 115.64 118.98 2eec s THR 36 Ca 0.10 1.37 0.00 0.00 0.31 0.00 0.00 61.69 63.47 2eec s THR 36 Cb -0.23 -3.88 0.00 0.00 0.01 0.00 0.00 72.50 68.40 2eec s THR 36 CO 0.09 -0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 2eec n GLY 37 N 3.60 2.41 3.68 4.40 0.00 -1.24 -4.92 105.19 113.12 2eec n GLY 37 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 2eec n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eec s ILE 38 N -2.37 4.07 -0.39 -0.61 1.01 -1.14 -5.08 121.20 116.70 2eec s ILE 38 Ca 0.00 -0.78 -0.24 0.00 0.00 0.00 0.00 60.65 59.63 2eec s ILE 38 Cb 0.00 -2.87 0.02 0.00 0.01 0.00 0.00 42.46 39.62 2eec s ILE 38 CO 0.00 0.27 0.85 -1.58 0.00 0.00 0.00 174.94 174.48 2eec s GLN 39 N -1.87 3.72 0.45 2.79 0.74 -1.26 -4.58 119.66 119.64 2eec s GLN 39 Ca 0.22 0.34 -0.04 0.00 0.05 0.00 0.00 55.36 55.93 2eec s GLN 39 Cb -0.12 -3.84 -0.04 0.00 1.10 0.00 0.00 33.01 30.12 2eec s GLN 39 CO 0.14 -0.96 0.73 -1.54 -0.55 0.00 0.00 175.29 173.11 2eec s SER 40 N 1.94 6.28 -0.16 6.67 1.04 -1.05 -4.94 113.70 123.48 2eec s SER 40 Ca 0.34 0.83 -0.11 0.00 0.48 0.00 0.00 55.95 57.49 2eec s SER 40 Cb -0.12 -2.20 0.05 0.00 0.10 0.00 0.00 66.02 63.84 2eec s SER 40 CO 0.19 -0.51 0.40 -1.83 0.98 0.00 0.00 173.24 172.47 2eec s GLU 41 N -4.60 0.42 -0.03 4.02 1.03 -1.26 -2.53 118.70 115.75 2eec s GLU 41 Ca 0.46 0.65 0.00 0.00 0.03 0.00 0.00 54.97 56.12 2eec s GLU 41 Cb -0.10 0.10 0.02 0.00 -0.80 0.00 0.00 34.13 33.35 2eec s GLU 41 CO 0.42 -0.11 -0.00 -0.59 -1.33 0.00 0.00 175.26 173.66 2eec s PHE 42 N 0.78 0.28 0.46 4.83 -0.71 -1.23 -2.63 117.98 119.76 2eec s PHE 42 Ca -0.05 0.01 -0.04 0.00 -1.04 0.00 0.00 56.93 55.81 2eec s PHE 42 Cb -0.06 -0.36 -0.03 0.00 -1.21 0.00 0.00 43.02 41.37 2eec s PHE 42 CO -0.06 -0.11 0.74 -0.06 -1.34 0.00 0.00 175.22 174.39 2eec s PHE 43 N 0.88 3.49 -0.28 3.49 0.08 -0.54 -3.03 117.98 122.07 2eec s PHE 43 Ca -0.09 0.66 0.02 0.00 0.12 0.00 0.00 56.93 57.64 2eec s PHE 43 Cb -0.12 -2.26 0.08 0.00 -0.57 0.00 0.00 43.02 40.15 2eec s PHE 43 CO -0.02 -0.25 -0.01 0.42 -0.10 0.00 0.00 175.22 175.26 2eec s ILE 44 N -2.66 1.77 -0.78 0.64 1.01 -0.65 -2.23 121.20 118.30 2eec s ILE 44 Ca 0.47 -1.65 -0.26 0.00 0.00 0.00 0.00 60.65 59.21 2eec s ILE 44 Cb -0.10 -2.13 -0.10 0.00 0.01 0.00 0.00 42.46 40.14 2eec s ILE 44 CO 0.43 -0.32 2.28 0.20 0.00 0.00 0.00 174.94 177.53 2eec s ASN 45 N 1.23 4.30 -0.21 3.58 -0.87 0.12 -3.94 114.94 119.14 2eec s ASN 45 Ca 0.01 0.01 0.14 0.00 -1.57 0.00 0.00 52.86 51.44 2eec s ASN 45 Cb -0.19 -2.55 0.45 0.00 -0.02 0.00 0.00 41.25 38.94 2eec s ASN 45 CO -0.09 -3.44 1.19 1.07 -2.57 0.00 0.00 177.10 173.25 2eec n THR 46 N 8.42 1.83 0.01 1.60 5.66 -1.26 -2.01 114.28 128.52 2eec n THR 46 Ca 0.43 -3.17 -0.15 0.00 -3.05 0.00 0.00 64.05 58.11 2eec n THR 46 Cb 0.46 -0.11 -0.14 0.00 -1.55 0.00 0.00 70.33 68.98 2eec n THR 46 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 175.07 172.73 2eec h THR 47 N 3.05 0.84 0.05 1.09 1.35 -1.83 -3.06 112.91 114.38 2eec h THR 47 Ca 0.07 -2.59 -0.23 0.00 -0.55 0.00 0.00 66.41 63.11 2eec h THR 47 Cb 1.37 2.53 -0.01 0.00 -1.73 0.00 0.00 68.15 70.30 2eec h THR 47 CO 0.30 0.72 -1.05 0.03 -0.25 0.00 0.00 175.52 175.27 2eec h ARG 48 N 0.04 0.13 0.27 4.72 3.08 -1.94 -3.37 114.38 117.32 2eec h ARG 48 Ca -0.33 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.51 2eec h ARG 48 Cb 2.02 0.07 0.00 0.00 0.08 0.00 0.00 29.97 32.14 2eec h ARG 48 CO 0.10 1.06 -0.13 0.00 -1.07 0.00 0.00 179.97 179.94 2eec h ALA 49 N 0.86 -0.38 0.00 0.04 0.00 -1.88 -3.50 119.26 114.40 2eec h ALA 49 Ca -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2eec h ALA 49 Cb 1.78 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.70 2eec h ALA 49 CO 0.16 -0.35 0.00 0.41 0.00 0.00 0.00 179.25 179.47 2eec n GLY 50 N 0.84 2.96 0.00 0.00 0.00 -1.16 -4.86 105.19 102.98 2eec n GLY 50 Ca -0.04 -0.47 0.07 0.00 0.00 0.00 0.00 46.02 45.58 2eec n GLY 50 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eec n PRO 51 N -0.76 0.33 -0.73 1.61 -0.04 -1.26 -4.71 135.00 129.44 2eec n PRO 51 Ca 0.00 0.08 -0.29 0.00 -0.04 0.00 0.00 63.50 63.26 2eec n PRO 51 Cb 0.00 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.08 2eec n PRO 51 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2eec n GLY 52 N -0.03 -2.54 3.71 0.55 0.00 -1.26 -4.89 105.19 100.73 2eec n GLY 52 Ca 0.09 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 2eec n GLY 52 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2eec s THR 53 N -2.11 4.98 0.39 2.61 -4.23 -1.26 -5.05 115.64 110.97 2eec s THR 53 Ca 0.42 1.62 0.04 0.00 -1.18 0.00 0.00 61.69 62.58 2eec s THR 53 Cb -0.03 -4.12 -0.01 0.00 1.34 0.00 0.00 72.50 69.68 2eec s THR 53 CO 0.54 0.20 0.56 -0.76 -0.54 0.00 0.00 174.62 174.62 2eec s LEU 54 N 1.05 3.83 -0.02 4.79 1.02 -1.26 -4.00 118.68 124.09 2eec s LEU 54 Ca 0.41 0.04 0.05 0.00 0.02 0.00 0.00 54.13 54.65 2eec s LEU 54 Cb -0.18 -2.95 -0.01 0.00 0.02 0.00 0.00 46.19 43.07 2eec s LEU 54 CO 0.20 -0.55 -0.17 -0.44 0.02 0.00 0.00 176.35 175.40 2eec s SER 55 N -4.19 2.08 0.00 2.29 0.01 -0.12 -4.97 113.70 108.80 2eec s SER 55 Ca 0.46 -0.33 -0.01 0.00 1.31 0.00 0.00 55.95 57.38 2eec s SER 55 Cb -0.10 -0.33 -0.01 0.00 0.21 0.00 0.00 66.02 65.79 2eec s SER 55 CO 0.34 0.20 0.02 0.68 0.41 0.00 0.00 173.24 174.89 2eec s VAL 56 N -0.28 0.06 -0.16 3.43 -7.23 -1.26 -0.73 120.40 114.23 2eec s VAL 56 Ca 0.04 -0.51 -0.04 0.00 -1.81 0.00 0.00 61.98 59.65 2eec s VAL 56 Cb -0.08 -0.20 0.06 0.00 0.56 0.00 0.00 36.38 36.72 2eec s VAL 56 CO 0.00 -0.28 0.12 -0.89 -0.31 0.00 0.00 175.10 173.73 2eec s THR 57 N -0.85 -0.15 0.25 5.32 2.01 -1.16 -5.01 115.64 116.05 2eec s THR 57 Ca -0.09 -0.06 -0.06 0.00 0.31 0.00 0.00 61.69 61.78 2eec s THR 57 Cb -0.06 -0.53 -0.06 0.00 0.01 0.00 0.00 72.50 71.86 2eec s THR 57 CO -0.00 -0.20 0.53 -0.63 -0.69 0.00 0.00 174.62 173.63 2eec s ILE 58 N 2.19 5.02 0.08 1.82 1.01 -1.26 -2.68 121.20 127.38 2eec s ILE 58 Ca 0.03 0.18 -0.01 0.00 0.00 0.00 0.00 60.65 60.85 2eec s ILE 58 Cb -0.15 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 2eec s ILE 58 CO -0.09 -0.19 0.00 -0.70 0.00 0.00 0.00 174.94 173.96 2eec s GLU 59 N -3.19 0.73 0.00 2.79 2.12 0.12 -4.95 118.70 116.31 2eec s GLU 59 Ca 0.45 -1.30 0.00 0.00 0.36 0.00 0.00 54.97 54.47 2eec s GLU 59 Cb -0.11 0.22 0.00 0.00 0.26 0.00 0.00 34.13 34.50 2eec s GLU 59 CO 0.26 -0.17 0.00 0.41 -0.54 0.00 0.00 175.26 175.23 2eec n GLY 60 N 0.03 0.97 0.23 -1.50 0.00 -1.26 -1.59 105.19 102.08 2eec n GLY 60 Ca -0.11 -1.18 -0.08 0.00 0.00 0.00 0.00 46.02 44.65 2eec n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eec h PRO 61 N 0.00 0.62 -5.69 1.61 0.13 -1.91 -3.43 132.00 123.33 2eec h PRO 61 Ca 0.00 -0.33 -0.66 0.00 -0.87 0.00 0.00 66.00 64.14 2eec h PRO 61 Cb 0.00 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 30.94 2eec h PRO 61 CO 0.00 0.93 -0.68 -1.12 -0.23 0.00 0.00 178.00 176.89 2eec s SER 62 N -6.86 4.69 0.21 1.44 0.01 -1.26 -5.10 113.70 106.84 2eec s SER 62 Ca -0.08 -0.08 -0.30 0.00 1.31 0.00 0.00 55.95 56.80 2eec s SER 62 Cb 0.12 -1.50 -0.08 0.00 0.21 0.00 0.00 66.02 64.77 2eec s SER 62 CO 0.83 0.26 1.13 -0.75 0.41 0.00 0.00 173.24 175.13 2eec s LYS 63 N -0.20 4.58 0.22 12.44 2.20 -1.26 -4.90 119.74 132.82 2eec s LYS 63 Ca 0.03 1.80 0.09 0.00 -0.36 0.00 0.00 55.97 57.52 2eec s LYS 63 Cb -0.13 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 32.91 2eec s LYS 63 CO 0.03 0.07 -0.02 0.14 -0.36 0.00 0.00 175.35 175.20 2eec s VAL 64 N -0.49 3.46 -0.76 4.02 -7.23 -1.26 -4.75 120.40 113.39 2eec s VAL 64 Ca 0.49 -1.72 -0.01 0.00 -1.81 0.00 0.00 61.98 58.92 2eec s VAL 64 Cb -0.31 -2.79 0.37 0.00 0.56 0.00 0.00 36.38 34.21 2eec s VAL 64 CO 0.38 -0.24 1.89 0.29 -0.31 0.00 0.00 175.10 177.10 2eec n LYS 65 N -0.48 2.85 -0.88 4.82 5.02 -1.26 -5.03 118.16 123.20 2eec n LYS 65 Ca -0.08 -3.64 -0.32 0.00 -2.02 0.00 0.00 58.31 52.25 2eec n LYS 65 Cb 0.57 -2.27 0.15 0.00 -0.02 0.00 0.00 35.03 33.46 2eec n LYS 65 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2eec s MET 66 N -3.97 1.30 0.06 1.97 0.23 -1.26 -4.84 119.30 112.80 2eec s MET 66 Ca 0.53 1.63 0.01 0.00 -1.03 0.00 0.00 55.69 56.83 2eec s MET 66 Cb 0.44 -1.75 -0.03 0.00 -1.53 0.00 0.00 34.83 31.96 2eec s MET 66 CO -0.33 -2.44 -0.06 -0.51 -2.03 0.00 0.00 175.02 169.65 2eec s ASP 67 N -2.47 0.84 -0.49 -1.18 1.01 -0.41 -4.99 116.67 108.98 2eec s ASP 67 Ca 0.69 -0.80 -0.01 0.00 0.71 0.00 0.00 52.55 53.14 2eec s ASP 67 Cb -0.25 0.09 0.13 0.00 1.01 0.00 0.00 42.92 43.90 2eec s ASP 67 CO 0.55 -0.38 0.27 0.00 0.21 0.00 0.00 175.17 175.81 2eec s GLN 69 N 0.48 3.99 0.63 0.00 -1.52 -1.10 -5.03 119.66 117.11 2eec s GLN 69 Ca 0.13 -0.26 -0.19 0.00 -1.95 0.00 0.00 55.36 53.09 2eec s GLN 69 Cb -0.22 -3.63 -0.02 0.00 -0.22 0.00 0.00 33.01 28.93 2eec s GLN 69 CO -0.04 -0.13 1.30 -1.83 -0.25 0.00 0.00 175.29 174.35 2eec s GLU 70 N 1.61 2.67 0.02 2.91 -1.05 -1.26 -3.28 118.70 120.32 2eec s GLU 70 Ca 0.08 2.09 -0.11 0.00 -0.15 0.00 0.00 54.97 56.89 2eec s GLU 70 Cb -0.15 -1.92 0.01 0.00 -0.44 0.00 0.00 34.13 31.62 2eec s GLU 70 CO 0.09 -1.51 0.22 0.95 0.95 0.00 0.00 175.26 175.96 2eec s THR 71 N -1.38 0.09 -0.63 1.83 -4.23 -1.25 -4.89 115.64 105.18 2eec s THR 71 Ca 0.81 -0.76 0.21 0.00 -1.18 0.00 0.00 61.69 60.76 2eec s THR 71 Cb -0.38 -0.78 0.21 0.00 1.34 0.00 0.00 72.50 72.88 2eec s THR 71 CO 0.41 -0.42 1.63 -0.81 -0.54 0.00 0.00 174.62 174.89 2eec n PRO 72 N 0.90 0.13 0.00 3.99 -0.04 -1.26 -2.42 135.00 136.30 2eec n PRO 72 Ca -0.20 0.38 -0.03 0.00 -0.04 0.00 0.00 63.50 63.61 2eec n PRO 72 Cb 0.58 -1.76 -0.11 0.00 -0.04 0.00 0.00 33.50 32.17 2eec n PRO 72 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2eec n GLU 73 N -2.01 0.63 0.00 0.54 2.13 -1.26 -5.05 120.64 115.62 2eec n GLU 73 Ca 0.02 0.20 0.00 0.00 0.66 0.00 0.00 57.16 58.04 2eec n GLU 73 Cb 0.21 -1.76 0.00 0.00 0.27 0.00 0.00 31.44 30.16 2eec n GLU 73 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2eec n GLY 74 N 1.47 -1.33 3.64 8.31 0.00 -1.02 -4.54 105.19 111.72 2eec n GLY 74 Ca -0.14 0.47 -0.04 0.00 0.00 0.00 0.00 46.02 46.32 2eec n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2eec s TYR 75 N 0.00 -1.20 -0.17 1.61 2.02 -1.25 -3.91 117.35 114.44 2eec s TYR 75 Ca 0.00 2.21 -0.01 0.00 -0.37 0.00 0.00 57.07 58.90 2eec s TYR 75 Cb 0.00 0.72 -0.00 0.00 -0.40 0.00 0.00 41.96 42.28 2eec s TYR 75 CO 0.00 -0.60 -0.13 0.21 -1.57 0.00 0.00 175.55 173.46 2eec s LYS 76 N 2.31 3.24 -0.29 -0.62 2.20 -1.21 -1.64 119.74 123.73 2eec s LYS 76 Ca -0.08 -0.72 -0.02 0.00 -0.36 0.00 0.00 55.97 54.79 2eec s LYS 76 Cb -0.09 -2.72 0.04 0.00 -1.51 0.00 0.00 37.83 33.55 2eec s LYS 76 CO -0.19 -0.06 -0.01 0.08 -0.36 0.00 0.00 175.35 174.81 2eec s VAL 77 N 1.02 3.08 -0.17 4.02 1.01 -1.17 -2.71 120.40 125.49 2eec s VAL 77 Ca -0.01 -1.21 -0.11 0.00 0.00 0.00 0.00 61.98 60.65 2eec s VAL 77 Cb -0.15 -2.69 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 2eec s VAL 77 CO -0.03 -0.00 0.21 -0.04 0.00 0.00 0.00 175.10 175.24 2eec s MET 78 N 1.30 4.12 -0.14 2.72 -1.94 -1.12 -3.56 119.30 120.69 2eec s MET 78 Ca -0.03 -0.06 -0.14 0.00 -1.71 0.00 0.00 55.69 53.76 2eec s MET 78 Cb -0.19 -3.39 0.04 0.00 2.01 0.00 0.00 34.83 33.30 2eec s MET 78 CO -0.02 0.35 0.39 1.52 -0.01 0.00 0.00 175.02 177.25 2eec s TYR 79 N 0.18 -0.41 -0.20 -0.03 -0.85 -1.05 -1.28 117.35 113.70 2eec s TYR 79 Ca 0.13 1.00 0.01 0.00 -0.52 0.00 0.00 57.07 57.69 2eec s TYR 79 Cb -0.12 0.14 0.04 0.00 0.38 0.00 0.00 41.96 42.40 2eec s TYR 79 CO 0.02 -0.22 -0.12 0.99 -1.52 0.00 0.00 175.55 174.70 2eec s THR 80 N 0.11 1.79 0.28 -3.49 2.01 -1.26 -2.54 115.64 112.54 2eec s THR 80 Ca -0.01 -1.06 -0.29 0.00 0.31 0.00 0.00 61.69 60.63 2eec s THR 80 Cb -0.03 -1.81 -0.10 0.00 0.01 0.00 0.00 72.50 70.58 2eec s THR 80 CO 0.01 0.23 1.25 -2.16 -0.69 0.00 0.00 174.62 173.25 2eec s PRO 81 N 1.34 4.45 -0.09 4.92 0.04 -1.26 -4.58 135.00 139.82 2eec s PRO 81 Ca -0.01 2.05 0.07 0.00 0.04 0.00 0.00 61.00 63.16 2eec s PRO 81 Cb -0.16 -3.14 -0.24 0.00 0.04 0.00 0.00 34.50 31.00 2eec s PRO 81 CO -0.09 -0.09 0.49 -0.12 0.04 0.00 0.00 177.00 177.23 2eec n MET 82 N 1.42 0.67 -4.11 4.56 1.56 -1.26 -3.65 117.12 116.31 2eec n MET 82 Ca 0.01 0.25 -0.13 0.00 -0.27 0.00 0.00 57.70 57.57 2eec n MET 82 Cb 0.43 -1.73 -0.11 0.00 2.15 0.00 0.00 33.22 33.96 2eec n MET 82 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2eec s ALA 83 N -2.57 0.79 1.13 -5.12 0.00 -1.26 -3.64 121.76 111.09 2eec s ALA 83 Ca -0.11 -1.01 -0.17 0.00 0.00 0.00 0.00 51.96 50.67 2eec s ALA 83 Cb 0.07 0.07 0.25 0.00 0.00 0.00 0.00 23.12 23.52 2eec s ALA 83 CO 0.80 -0.08 1.10 -1.25 0.00 0.00 0.00 175.76 176.33 2eec s PRO 84 N -2.45 -0.65 0.00 0.00 0.04 -1.26 -4.82 135.00 125.85 2eec s PRO 84 Ca -0.01 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.17 2eec s PRO 84 Cb -0.04 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.85 2eec s PRO 84 CO -0.01 -3.37 0.00 0.41 0.04 0.00 0.00 177.00 174.07 2eec n GLY 85 N -1.00 0.89 3.40 0.56 0.00 -1.24 -4.86 105.19 102.95 2eec n GLY 85 Ca 0.10 -1.96 -0.36 0.00 0.00 0.00 0.00 46.02 43.80 2eec n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eec s ASN 86 N -4.00 4.78 0.06 1.61 2.20 -1.26 -1.57 114.94 116.76 2eec s ASN 86 Ca 0.00 -0.27 0.06 0.00 -0.94 0.00 0.00 52.86 51.70 2eec s ASN 86 Cb 0.00 -1.84 -0.04 0.00 -2.00 0.00 0.00 41.25 37.37 2eec s ASN 86 CO 0.00 -0.01 -0.09 -0.31 -2.94 0.00 0.00 177.10 173.75 2eec s TYR 87 N 1.47 2.80 -0.13 1.54 1.51 -1.01 -4.38 117.35 119.15 2eec s TYR 87 Ca 0.05 -0.11 0.02 0.00 -1.01 0.00 0.00 57.07 56.03 2eec s TYR 87 Cb -0.15 -1.50 0.01 0.00 -0.11 0.00 0.00 41.96 40.21 2eec s TYR 87 CO 0.01 0.40 -0.21 -1.17 -1.11 0.00 0.00 175.55 173.46 2eec s LEU 88 N -1.89 2.06 -0.20 -1.29 2.96 -0.62 -2.58 118.68 117.11 2eec s LEU 88 Ca 0.20 -0.58 0.01 0.00 -0.22 0.00 0.00 54.13 53.54 2eec s LEU 88 Cb -0.11 -1.40 0.04 0.00 0.50 0.00 0.00 46.19 45.22 2eec s LEU 88 CO 0.11 0.08 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.46 2eec s ILE 89 N 0.81 1.84 0.18 6.68 1.01 -0.66 0.10 121.20 131.17 2eec s ILE 89 Ca -0.08 -1.07 0.06 0.00 0.00 0.00 0.00 60.65 59.57 2eec s ILE 89 Cb -0.16 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 2eec s ILE 89 CO -0.01 0.26 0.12 -0.55 0.00 0.00 0.00 174.94 174.75 2eec s SER 90 N 1.32 5.36 -0.04 3.58 0.15 -1.09 -1.12 113.70 121.85 2eec s SER 90 Ca -0.00 -0.21 -0.01 0.00 0.70 0.00 0.00 55.95 56.43 2eec s SER 90 Cb -0.16 -1.34 0.03 0.00 -1.71 0.00 0.00 66.02 62.84 2eec s SER 90 CO -0.09 0.06 0.01 -0.69 1.20 0.00 0.00 173.24 173.73 2eec s VAL 91 N -1.82 0.17 -0.04 4.45 1.01 -1.26 -3.01 120.40 119.90 2eec s VAL 91 Ca 0.31 0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.50 2eec s VAL 91 Cb -0.09 -0.32 -0.01 0.00 0.00 0.00 0.00 36.38 35.96 2eec s VAL 91 CO 0.23 0.18 -0.17 -0.54 0.00 0.00 0.00 175.10 174.80 2eec s LYS 92 N 1.52 1.70 -0.43 2.72 1.02 0.09 -1.50 119.74 124.86 2eec s LYS 92 Ca -0.03 -0.62 -0.09 0.00 0.02 0.00 0.00 55.97 55.25 2eec s LYS 92 Cb -0.13 -1.52 0.08 0.00 -0.52 0.00 0.00 37.83 35.75 2eec s LYS 92 CO -0.03 0.28 0.27 -0.47 -0.92 0.00 0.00 175.35 174.48 2eec s TYR 93 N -0.07 3.35 -1.14 3.18 5.04 -1.26 -0.95 117.35 125.50 2eec s TYR 93 Ca -0.01 -1.57 -0.08 0.00 -2.44 0.00 0.00 57.07 52.97 2eec s TYR 93 Cb -0.10 -3.03 0.01 0.00 0.35 0.00 0.00 41.96 39.19 2eec s TYR 93 CO 0.01 -0.87 0.14 0.41 -1.34 0.00 0.00 175.55 173.91 2eec n GLY 94 N 4.92 -0.24 0.00 8.97 0.00 -1.26 -4.79 105.19 112.78 2eec n GLY 94 Ca -0.10 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2eec n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eec n GLY 95 N -2.13 1.37 0.00 -0.02 0.00 -1.26 -4.99 105.19 98.15 2eec n GLY 95 Ca -0.21 -0.49 0.08 0.00 0.00 0.00 0.00 46.02 45.39 2eec n GLY 95 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eec n PRO 96 N -0.22 0.47 -3.58 1.61 -0.04 -1.26 -4.69 135.00 127.29 2eec n PRO 96 Ca 0.00 0.01 -0.37 0.00 -0.04 0.00 0.00 63.50 63.10 2eec n PRO 96 Cb 0.00 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.89 2eec n PRO 96 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2eec s ASN 97 N -2.03 6.49 0.79 3.54 0.01 -1.26 -5.09 114.94 117.39 2eec s ASN 97 Ca 0.23 0.58 -0.12 0.00 -0.71 0.00 0.00 52.86 52.84 2eec s ASN 97 Cb 0.11 -2.18 0.06 0.00 0.41 0.00 0.00 41.25 39.65 2eec s ASN 97 CO 0.18 0.18 1.13 -1.38 -1.51 0.00 0.00 177.10 175.71 2eec s HIS 98 N -0.01 3.00 0.84 2.20 -3.43 -1.26 -4.05 115.29 112.58 2eec s HIS 98 Ca 0.17 0.93 -0.07 0.00 -0.80 0.00 0.00 55.06 55.30 2eec s HIS 98 Cb -0.13 -3.28 0.17 0.00 -1.43 0.00 0.00 32.58 27.91 2eec s HIS 98 CO 0.05 -1.65 1.15 0.96 -2.00 0.00 0.00 174.74 173.25 2eec s ILE 99 N -3.40 2.03 0.52 -5.38 -4.36 -0.56 -4.79 121.20 105.26 2eec s ILE 99 Ca 0.61 -0.37 -0.21 0.00 -0.26 0.00 0.00 60.65 60.42 2eec s ILE 99 Cb -0.12 -2.66 -0.06 0.00 1.25 0.00 0.00 42.46 40.87 2eec s ILE 99 CO 0.51 0.00 1.17 -0.69 0.24 0.00 0.00 174.94 176.17 2eec s VAL 100 N -3.48 3.01 0.00 8.37 1.01 -1.26 -3.41 120.40 124.64 2eec s VAL 100 Ca 0.71 0.69 0.00 0.00 0.00 0.00 0.00 61.98 63.38 2eec s VAL 100 Cb -0.04 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 33.03 2eec s VAL 100 CO 0.48 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 176.11 2eec n GLY 101 N 0.35 1.73 3.70 4.51 0.00 -1.26 -4.92 105.19 109.29 2eec n GLY 101 Ca 0.10 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 2eec n GLY 101 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eec s SER 102 N 0.00 3.36 0.47 1.61 0.01 -1.22 -4.49 113.70 113.44 2eec s SER 102 Ca 0.00 2.01 -0.23 0.00 1.31 0.00 0.00 55.95 59.04 2eec s SER 102 Cb 0.00 -2.52 -0.07 0.00 0.21 0.00 0.00 66.02 63.64 2eec s SER 102 CO 0.00 -2.79 1.16 -2.16 0.41 0.00 0.00 173.24 169.86 2eec s PRO 103 N -4.74 3.72 -0.11 12.44 0.04 -1.26 -4.87 135.00 140.23 2eec s PRO 103 Ca 0.65 1.76 -0.24 0.00 0.04 0.00 0.00 61.00 63.20 2eec s PRO 103 Cb -0.21 -2.37 -0.03 0.00 0.04 0.00 0.00 34.50 31.94 2eec s PRO 103 CO 0.58 -0.58 0.74 -0.06 0.04 0.00 0.00 177.00 177.72 2eec s PHE 104 N -1.57 3.51 -0.60 0.56 0.08 -0.28 -4.94 117.98 114.74 2eec s PHE 104 Ca 0.64 1.23 -0.06 0.00 0.12 0.00 0.00 56.93 58.86 2eec s PHE 104 Cb -0.28 -2.88 0.16 0.00 -0.57 0.00 0.00 43.02 39.45 2eec s PHE 104 CO 0.34 -0.05 0.44 0.15 -0.10 0.00 0.00 175.22 176.00 2eec s LYS 105 N 1.35 2.63 0.09 0.44 1.02 -1.26 -1.65 119.74 122.35 2eec s LYS 105 Ca 0.37 -2.28 -0.10 0.00 0.02 0.00 0.00 55.97 53.99 2eec s LYS 105 Cb -0.17 -3.86 -0.06 0.00 -0.52 0.00 0.00 37.83 33.22 2eec s LYS 105 CO 0.16 -1.18 0.41 0.00 -0.92 0.00 0.00 175.35 173.82 2eec s ALA 106 N 0.41 3.72 -0.14 5.17 0.00 -1.07 -5.00 121.76 124.86 2eec s ALA 106 Ca 0.14 -0.37 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 2eec s ALA 106 Cb -0.20 -2.28 -0.02 0.00 0.00 0.00 0.00 23.12 20.62 2eec s ALA 106 CO -0.04 0.56 -0.10 0.21 0.00 0.00 0.00 175.76 176.39 2eec s LYS 107 N -1.95 3.47 -0.07 0.00 2.47 -1.26 -2.39 119.74 120.01 2eec s LYS 107 Ca 0.34 -0.64 -0.09 0.00 -1.56 0.00 0.00 55.97 54.02 2eec s LYS 107 Cb -0.14 -2.72 -0.05 0.00 -1.46 0.00 0.00 37.83 33.46 2eec s LYS 107 CO 0.18 0.21 0.23 0.08 0.16 0.00 0.00 175.35 176.22 2eec s VAL 108 N 0.39 5.34 0.46 4.02 1.01 -0.61 -0.31 120.40 130.70 2eec s VAL 108 Ca -0.08 0.39 -0.06 0.00 0.00 0.00 0.00 61.98 62.23 2eec s VAL 108 Cb -0.15 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 2eec s VAL 108 CO 0.05 0.58 0.77 0.42 0.00 0.00 0.00 175.10 176.91 2eec s THR 109 N -1.08 4.89 0.00 3.92 -4.23 -0.74 -3.59 115.64 114.82 2eec s THR 109 Ca 0.19 0.27 0.00 0.00 -1.18 0.00 0.00 61.69 60.97 2eec s THR 109 Cb -0.14 -3.84 0.00 0.00 1.34 0.00 0.00 72.50 69.87 2eec s THR 109 CO 0.08 -0.76 0.00 0.61 -0.54 0.00 0.00 174.62 174.01 2eec n GLY 110 N -2.02 0.00 3.48 3.99 0.00 -1.26 -4.42 105.19 104.96 2eec n GLY 110 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 2eec n GLY 110 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2eec n GLN 111 N 0.00 -0.88 -1.55 1.61 1.13 -1.26 -4.32 117.38 112.10 2eec n GLN 111 Ca 0.00 0.07 -0.37 0.00 -1.94 0.00 0.00 57.00 54.76 2eec n GLN 111 Cb 0.00 -2.58 0.06 0.00 0.11 0.00 0.00 30.24 27.83 2eec n GLN 111 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2eec n ARG 112 N -2.91 0.76 -3.69 -1.09 1.74 -1.26 -4.67 116.66 105.54 2eec n ARG 112 Ca -0.05 0.31 -0.37 0.00 -0.77 0.00 0.00 57.85 56.96 2eec n ARG 112 Cb 0.34 -2.16 -0.09 0.00 -1.02 0.00 0.00 32.46 29.53 2eec n ARG 112 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2eec s LEU 113 N -2.22 5.36 -0.03 0.55 1.43 -1.24 -5.06 118.68 117.48 2eec s LEU 113 Ca 0.76 -2.64 0.05 0.00 -1.03 0.00 0.00 54.13 51.27 2eec s LEU 113 Cb -0.39 -1.88 -0.02 0.00 0.03 0.00 0.00 46.19 43.92 2eec s LEU 113 CO 0.48 -0.43 -0.19 -0.69 0.23 0.00 0.00 176.35 175.74 2eec s VAL 114 N 0.26 2.67 0.17 -1.59 1.01 -1.26 -5.00 120.40 116.66 2eec s VAL 114 Ca 0.15 -0.89 -0.26 0.00 0.00 0.00 0.00 61.98 60.97 2eec s VAL 114 Cb -0.20 -2.01 -0.08 0.00 0.00 0.00 0.00 36.38 34.08 2eec s VAL 114 CO -0.04 0.57 0.81 -0.55 0.00 0.00 0.00 175.10 175.89 2eec s SER 115 N -0.73 7.44 0.09 3.32 0.15 -1.26 -4.99 113.70 117.72 2eec s SER 115 Ca 0.11 1.70 -0.15 0.00 0.70 0.00 0.00 55.95 58.31 2eec s SER 115 Cb -0.10 -2.52 -0.09 0.00 -1.71 0.00 0.00 66.02 61.59 2eec s SER 115 CO 0.00 0.19 1.41 1.55 1.20 0.00 0.00 173.24 177.60 2eec h PRO 116 N 4.36 0.66 -2.82 5.44 0.13 -2.05 -3.35 132.00 134.36 2eec h PRO 116 Ca -0.46 -0.35 -0.70 0.00 -0.87 0.00 0.00 66.00 63.62 2eec h PRO 116 Cb 1.21 0.01 -0.35 0.00 0.13 0.00 0.00 31.00 31.99 2eec h PRO 116 CO 0.67 0.95 0.01 0.41 -0.23 0.00 0.00 178.00 179.81 2eec n GLY 117 N 0.16 4.68 3.48 1.56 0.00 -1.26 -5.02 105.19 108.79 2eec n GLY 117 Ca -0.04 -2.68 -0.43 0.00 0.00 0.00 0.00 46.02 42.87 2eec n GLY 117 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eec s SER 118 N -1.43 6.25 -0.17 1.61 0.15 -1.26 -4.99 113.70 113.87 2eec s SER 118 Ca 0.33 -0.74 -0.09 0.00 0.70 0.00 0.00 55.95 56.15 2eec s SER 118 Cb 0.04 -2.39 0.06 0.00 -1.71 0.00 0.00 66.02 62.01 2eec s SER 118 CO -0.02 -1.23 0.40 0.00 1.20 0.00 0.00 173.24 173.60 2eec s ALA 119 N 3.67 -1.03 -0.37 5.45 0.00 -1.26 -5.13 121.76 123.09 2eec s ALA 119 Ca 0.24 1.49 -0.23 0.00 0.00 0.00 0.00 51.96 53.45 2eec s ALA 119 Cb -0.16 -0.90 0.01 0.00 0.00 0.00 0.00 23.12 22.07 2eec s ALA 119 CO 0.14 -0.26 0.77 1.21 0.00 0.00 0.00 175.76 177.62 2eec s ASN 120 N 1.31 6.53 -0.51 0.00 3.84 -1.26 -5.00 114.94 119.85 2eec s ASN 120 Ca -0.09 0.32 0.03 0.00 0.21 0.00 0.00 52.86 53.33 2eec s ASN 120 Cb -0.08 -2.39 0.14 0.00 -0.55 0.00 0.00 41.25 38.37 2eec s ASN 120 CO -0.12 -0.72 0.29 -0.70 -2.79 0.00 0.00 177.10 173.06 2eec s GLU 121 N 3.05 1.77 0.18 0.43 2.56 -1.26 -5.10 118.70 120.34 2eec s GLU 121 Ca 0.30 -2.50 -0.13 0.00 0.00 0.00 0.00 54.97 52.65 2eec s GLU 121 Cb -0.13 -2.93 -0.07 0.00 2.00 0.00 0.00 34.13 32.99 2eec s GLU 121 CO 0.17 -1.16 0.56 0.95 -0.56 0.00 0.00 175.26 175.21 2eec s THR 122 N -0.23 4.87 1.06 -1.70 -4.23 -1.26 -5.06 115.64 109.09 2eec s THR 122 Ca 0.19 0.73 -0.16 0.00 -1.18 0.00 0.00 61.69 61.26 2eec s THR 122 Cb -0.21 -3.70 0.08 0.00 1.34 0.00 0.00 72.50 70.01 2eec s THR 122 CO -0.03 0.13 0.17 -0.24 -0.54 0.00 0.00 174.62 174.12 2eec n SER 123 N 0.48 -2.26 0.02 3.99 2.88 -1.26 -5.00 113.62 112.47 2eec n SER 123 Ca -0.03 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 2eec n SER 123 Cb 0.52 -1.06 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 2eec n SER 123 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2eec n SER 124 N -1.58 0.23 0.00 -3.46 2.88 -1.26 -5.32 113.62 105.10 2eec n SER 124 Ca 0.03 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 2eec n SER 124 Cb 0.59 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 2eec n SER 124 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81